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The model defined in |
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Hi, I want to do MD simulation for 0.1 M NaCl aqueous solution.
Based on the previous pure water model developed by other people (e.g. H2O model uploaded at AIS square; https://www.aissquare.com/datasets/detail?pageType=datasets&name=H2O-SCAN0), I want to make another model to simulate 0.1 M NaCl solution.
This is the strategy that I thought.
However, it seems not working.
Can you guide me how to use the "-f" option appropriately?
I think it doesn't work even though I make my own model and use it from the pre_trained model with same data using "-f" option.
Thanks in advance
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